ethyl 2-[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(2-bromo-4-propan-2-ylphenoxy)-1-oxoethyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-bromo-4-propan-2-ylphenoxy)acetyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H28BrNO5S MolecularWeight: 546.47322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)COC3=C(C=C(C=C3)C(C)C)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)COC3=C(C=C(C=C3)C(C)C)Br

InChI

InChI=1S/C26H28BrNO5S/c1-5-31-19-10-7-17(8-11-19)20-15-34-25(24(20)26(30)32-6-2)28-23(29)14-33-22-12-9-18(16(3)4)13-21(22)27/h7-13,15-16H,5-6,14H2,1-4H3,(H,28,29)